Sodium (6R,7R)-3-(Acetyloxymethyl)-7-Amino-8-Oxo-5-Thia-1-Azabicyclo[4.2.0]Oct-2-Ene-2-Carboxylate
[CAS# 40994-22-7]

Identification

• Name: Sodium (6R,7R)-3-(Acetyloxymethyl)-7-Amino-8-Oxo-5-Thia-1-Azabicyclo[4.2.0]Oct-2-Ene-2-Carboxylate
• Synonyms: Sodium (6R,7R)-3-(Acetoxymethyl)-7-Amino-8-Oxo-5-Thia-1-Azabicyclo[4.2.0]Oct-2-Ene-2-Carboxylate; Sodium (6R,7R)-3-(Acetoxymethyl)-7-Amino-8-Keto-5-Thia-1-Azabicyclo[4.2.0]Oct-2-Ene-2-Carboxylate
• Molecular Formula: C₁₀H₁₁N₂NaO₅S
• Molecular Weight: 294.26
• CAS Registry Number: 40994-22-7
• EINECS: 255-169-5
• SMILES: [C@H]12SCC(=C(N1C(=O)[C@H]2N)C([O-])=O)COC(=O)C.[Na+]
• InChI: 1S/C10H12N2O5S.Na/c1-4(13)17-2-5-3-18-9-6(11)8(14)12(9)7(5)10(15)16;/h6,9H,2-3,11H2,1H3,(H,15,16);/q;+1/p-1/t6-,9-;/m1./s1
• InChIKey: PVCIUMOLXPZFHR-SOWVLMPRSA-M

Properties

• Boiling point: 560.6°C at 760 mmHg (Cal.)
• Flash point: 292.9°C (Cal.)